In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2010 | 15 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.76 | 0.93 | -42.71 | 4 | 4 | 1 | 60 | 216.349 | 8 | ↓ |
Lo Low (pH 4.5-6) | 0.76 | 2.97 | -121.94 | 5 | 4 | 2 | 61 | 217.357 | 8 | ↓ |